tert-butyl 3-[[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[2-(2-furyl)-2-pyrrolidino-ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCC(C2=CC=CO2)N3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCC(C2=CC=CO2)N3CCCC3

InChI

InChI=1S/C21H33N3O4/c1-21(2,3)28-20(26)24-12-6-8-16(15-24)19(25)22-14-17(18-9-7-13-27-18)23-10-4-5-11-23/h7,9,13,16-17H,4-6,8,10-12,14-15H2,1-3H3,(H,22,25)